2,6-ditert-butyl-4-[4-(4-ethoxy-3-nitro-phenyl)-5-phenyl-1,3-dihydroimidazol-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-ditert-butyl-4-[4-(4-ethoxy-3-nitro-phenyl)-5-phenyl-1,3-dihydroimidazol-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2,6-ditert-butyl-4-[4-(4-ethoxy-3-nitro-phenyl)-5-phenyl-1,3-dihydroimidazol-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 2,6-ditert-butyl-4-[4-(4-ethoxy-3-nitrophenyl)-5-phenyl-1,3-dihydroimidazol-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-ditert-butyl-4-[4-(4-ethoxy-3-nitrophenyl)-5-phenyl-1,3-dihydroimidazol-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2,6-ditert-butyl-4-[4-(4-ethoxy-3-nitro-phenyl)-5-phenyl-4-imidazolin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C31H35N3O4 MolecularWeight: 513.6273

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=C(NC(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)N2)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=C(NC(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)N2)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C31H35N3O4/c1-8-38-25-15-14-20(18-24(25)34(36)37)27-26(19-12-10-9-11-13-19)32-29(33-27)21-16-22(30(2,3)4)28(35)23(17-21)31(5,6)7/h9-18,32-33H,8H2,1-7H3